Geometry & MOs

Info

ID:	278326
PubChem CID:	103834838
Reduced:	NS2O5C8H17 (1)
Stoich.:	AB2C5D8E17 (1)
Weight, g/mol:	358.93192
ΔH_f, kcal/mol:	-220.27
Dipole, Da:	5.01
IP(EA), eV:	-8.95(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[2-(3-hydroxypropylsulfanyl)ethyl]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

COC(=O)CS(=O)(=O)NCCSCCCO

DOS

IR

Vibrations